USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 603 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 104 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 101 MET CE :methyl -170:sc= -0.557 (180deg=-0.782) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 CYS SG : rot -159:sc= -0.0158 USER MOD Single : A 113 SER OG : rot -110:sc= 0.0661 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=-0.071) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 129 ASN : amide:sc=-0.00356 X(o=-0.0036,f=-0.34) USER MOD Single : A 134 CYS SG : rot -24:sc= 0.0173 USER MOD Single : A 138 SER OG : rot -81:sc= 0.831 USER MOD Single : A 145 SER OG : rot -90:sc= -0.0713 USER MOD Single : A 146 GLN : amide:sc= 0.0119 X(o=0.012,f=-0.032) USER MOD Single : A 149 TYR OH : rot 25:sc= 1.32 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 ASN : amide:sc= 0.556 K(o=0.56,f=-4.9!) USER MOD Single : A 158 HIS : no HE2:sc= 0.746 K(o=0.75,f=-2.7!) USER MOD Single : A 160 SER OG : rot -160:sc= 1.3 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot 176:sc= 1.15 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0.197 K(o=0.2,f=-6.1!) USER MOD ----------------------------------------------------------------- ATOM 306 N HIS A 100 62.761 9.120 -11.920 1.00 25.00 N ATOM 307 CA HIS A 100 62.826 10.170 -10.926 1.00 25.00 C ATOM 308 C HIS A 100 63.917 9.764 -9.960 1.00 25.00 C ATOM 309 O HIS A 100 64.273 8.592 -9.896 1.00 25.00 O ATOM 310 CB HIS A 100 61.481 10.347 -10.206 1.00 25.00 C ATOM 311 CG HIS A 100 61.051 9.149 -9.417 1.00 25.00 C ATOM 312 ND1 HIS A 100 60.532 7.999 -9.962 1.00 25.00 N ATOM 313 CD2 HIS A 100 61.054 8.929 -8.072 1.00 25.00 C ATOM 314 CE1 HIS A 100 60.243 7.162 -8.972 1.00 25.00 C ATOM 315 NE2 HIS A 100 60.539 7.678 -7.796 1.00 25.00 N ATOM 0 HA HIS A 100 63.045 11.133 -11.387 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.549 11.205 -9.537 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.713 10.578 -10.944 1.00 25.00 H new ATOM 0 HD2 HIS A 100 61.407 9.630 -7.331 1.00 25.00 H new ATOM 0 HE1 HIS A 100 59.818 6.179 -9.113 1.00 25.00 H new ATOM 0 HE2 HIS A 100 60.415 7.247 -6.880 1.00 25.00 H new ATOM 323 N MET A 101 64.461 10.739 -9.257 1.00 25.00 N ATOM 324 CA MET A 101 65.547 10.531 -8.312 1.00 25.00 C ATOM 325 C MET A 101 65.352 11.525 -7.181 1.00 25.00 C ATOM 326 O MET A 101 64.729 12.578 -7.373 1.00 25.00 O ATOM 327 CB MET A 101 66.899 10.741 -9.007 1.00 25.00 C ATOM 328 CG MET A 101 67.055 12.083 -9.685 1.00 25.00 C ATOM 329 SD MET A 101 68.640 12.211 -10.509 1.00 25.00 S ATOM 330 CE MET A 101 68.715 13.966 -10.795 1.00 25.00 C ATOM 0 H MET A 101 64.159 11.711 -9.325 1.00 25.00 H new ATOM 0 HA MET A 101 65.541 9.513 -7.922 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.694 10.626 -8.270 1.00 25.00 H new ATOM 0 HB3 MET A 101 67.037 9.955 -9.749 1.00 25.00 H new ATOM 0 HG2 MET A 101 66.253 12.223 -10.410 1.00 25.00 H new ATOM 0 HG3 MET A 101 66.960 12.880 -8.947 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.553 14.192 -11.455 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.787 14.299 -11.260 1.00 25.00 H new ATOM 0 HE3 MET A 101 68.851 14.484 -9.846 1.00 25.00 H new ATOM 340 N LEU A 102 65.840 11.180 -5.999 1.00 25.00 N ATOM 341 CA LEU A 102 65.695 12.036 -4.820 1.00 25.00 C ATOM 342 C LEU A 102 67.040 12.666 -4.485 1.00 25.00 C ATOM 343 O LEU A 102 68.022 11.958 -4.294 1.00 25.00 O ATOM 344 CB LEU A 102 65.196 11.206 -3.630 1.00 25.00 C ATOM 345 CG LEU A 102 64.835 12.003 -2.363 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.512 12.755 -2.540 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.726 11.057 -1.171 1.00 25.00 C ATOM 0 H LEU A 102 66.343 10.310 -5.825 1.00 25.00 H new ATOM 0 HA LEU A 102 64.969 12.822 -5.030 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.317 10.644 -3.946 1.00 25.00 H new ATOM 0 HB3 LEU A 102 65.964 10.477 -3.372 1.00 25.00 H new ATOM 0 HG LEU A 102 65.625 12.733 -2.186 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.283 13.308 -1.629 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.598 13.450 -3.375 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.712 12.042 -2.742 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.470 11.626 -0.277 1.00 25.00 H new ATOM 0 HD22 LEU A 102 63.950 10.316 -1.364 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.680 10.552 -1.019 1.00 25.00 H new ATOM 359 N LEU A 103 67.089 13.987 -4.428 1.00 25.00 N ATOM 360 CA LEU A 103 68.325 14.723 -4.141 1.00 25.00 C ATOM 361 C LEU A 103 68.132 15.499 -2.855 1.00 25.00 C ATOM 362 O LEU A 103 67.008 15.815 -2.490 1.00 25.00 O ATOM 363 CB LEU A 103 68.632 15.704 -5.276 1.00 25.00 C ATOM 364 CG LEU A 103 69.566 15.217 -6.397 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.082 13.947 -7.067 1.00 25.00 C ATOM 366 CD2 LEU A 103 69.684 16.336 -7.420 1.00 25.00 C ATOM 0 H LEU A 103 66.277 14.586 -4.578 1.00 25.00 H new ATOM 0 HA LEU A 103 69.154 14.021 -4.047 1.00 25.00 H new ATOM 0 HB2 LEU A 103 67.687 16.001 -5.730 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.070 16.600 -4.838 1.00 25.00 H new ATOM 0 HG LEU A 103 70.533 14.973 -5.957 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.785 13.657 -7.848 1.00 25.00 H new ATOM 0 HD12 LEU A 103 69.012 13.149 -6.327 1.00 25.00 H new ATOM 0 HD13 LEU A 103 68.100 14.120 -7.508 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.342 16.021 -8.230 1.00 25.00 H new ATOM 0 HD22 LEU A 103 68.698 16.567 -7.822 1.00 25.00 H new ATOM 0 HD23 LEU A 103 70.097 17.224 -6.942 1.00 25.00 H new ATOM 378 N THR A 104 69.222 15.825 -2.181 1.00 25.00 N ATOM 379 CA THR A 104 69.159 16.564 -0.919 1.00 25.00 C ATOM 380 C THR A 104 69.754 17.956 -1.098 1.00 25.00 C ATOM 381 O THR A 104 70.769 18.128 -1.768 1.00 25.00 O ATOM 382 CB THR A 104 69.925 15.808 0.181 1.00 25.00 C ATOM 383 OG1 THR A 104 69.487 14.448 0.203 1.00 25.00 O ATOM 384 CG2 THR A 104 69.678 16.403 1.563 1.00 25.00 C ATOM 0 H THR A 104 70.168 15.591 -2.483 1.00 25.00 H new ATOM 0 HA THR A 104 68.114 16.657 -0.622 1.00 25.00 H new ATOM 0 HB THR A 104 70.988 15.885 -0.047 1.00 25.00 H new ATOM 0 HG1 THR A 104 69.972 13.959 0.900 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.238 15.838 2.308 1.00 25.00 H new ATOM 0 HG22 THR A 104 70.005 17.443 1.575 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.614 16.354 1.795 1.00 25.00 H new ATOM 392 N VAL A 105 69.112 18.955 -0.517 1.00 25.00 N ATOM 393 CA VAL A 105 69.569 20.334 -0.607 1.00 25.00 C ATOM 394 C VAL A 105 69.731 20.895 0.799 1.00 25.00 C ATOM 395 O VAL A 105 68.786 20.909 1.585 1.00 25.00 O ATOM 396 CB VAL A 105 68.538 21.205 -1.360 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.032 22.663 -1.496 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.210 20.614 -2.744 1.00 25.00 C ATOM 0 H VAL A 105 68.260 18.835 0.030 1.00 25.00 H new ATOM 0 HA VAL A 105 70.516 20.351 -1.146 1.00 25.00 H new ATOM 0 HB VAL A 105 67.622 21.210 -0.769 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.286 23.252 -2.030 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.188 23.088 -0.505 1.00 25.00 H new ATOM 0 HG13 VAL A 105 69.971 22.679 -2.050 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.482 21.250 -3.248 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.120 20.560 -3.342 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.795 19.613 -2.623 1.00 25.00 H new ATOM 408 N TYR A 106 70.921 21.386 1.104 1.00 25.00 N ATOM 409 CA TYR A 106 71.172 22.055 2.373 1.00 25.00 C ATOM 410 C TYR A 106 71.212 23.553 2.108 1.00 25.00 C ATOM 411 O TYR A 106 72.035 24.028 1.332 1.00 25.00 O ATOM 412 CB TYR A 106 72.497 21.578 2.974 1.00 25.00 C ATOM 413 CG TYR A 106 72.832 22.198 4.323 1.00 25.00 C ATOM 414 CD1 TYR A 106 71.817 22.526 5.249 1.00 25.00 C ATOM 415 CD2 TYR A 106 74.170 22.448 4.686 1.00 25.00 C ATOM 416 CE1 TYR A 106 72.129 23.080 6.511 1.00 25.00 C ATOM 417 CE2 TYR A 106 74.488 23.008 5.957 1.00 25.00 C ATOM 418 CZ TYR A 106 73.458 23.323 6.854 1.00 25.00 C ATOM 419 OH TYR A 106 73.748 23.872 8.075 1.00 25.00 O ATOM 0 H TYR A 106 71.732 21.334 0.488 1.00 25.00 H new ATOM 0 HA TYR A 106 70.384 21.821 3.089 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.463 20.494 3.084 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.302 21.803 2.274 1.00 25.00 H new ATOM 0 HD1 TYR A 106 70.784 22.350 4.988 1.00 25.00 H new ATOM 0 HD2 TYR A 106 74.964 22.212 3.993 1.00 25.00 H new ATOM 0 HE1 TYR A 106 71.339 23.315 7.209 1.00 25.00 H new ATOM 0 HE2 TYR A 106 75.518 23.189 6.228 1.00 25.00 H new ATOM 0 HH TYR A 106 74.718 23.978 8.164 1.00 25.00 H new ATOM 429 N CYS A 107 70.312 24.292 2.729 1.00 25.00 N ATOM 430 CA CYS A 107 70.256 25.734 2.567 1.00 25.00 C ATOM 431 C CYS A 107 70.980 26.387 3.732 1.00 25.00 C ATOM 432 O CYS A 107 70.665 26.134 4.891 1.00 25.00 O ATOM 433 CB CYS A 107 68.804 26.211 2.538 1.00 25.00 C ATOM 434 SG CYS A 107 68.657 28.002 2.335 1.00 25.00 S ATOM 0 H CYS A 107 69.603 23.913 3.357 1.00 25.00 H new ATOM 0 HA CYS A 107 70.732 26.009 1.626 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.279 25.713 1.722 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.310 25.913 3.463 1.00 25.00 H new ATOM 0 HG CYS A 107 67.489 28.391 2.751 1.00 25.00 H new ATOM 440 N VAL A 108 71.948 27.229 3.412 1.00 25.00 N ATOM 441 CA VAL A 108 72.723 27.949 4.409 1.00 25.00 C ATOM 442 C VAL A 108 72.472 29.436 4.234 1.00 25.00 C ATOM 443 O VAL A 108 72.624 29.981 3.138 1.00 25.00 O ATOM 444 CB VAL A 108 74.240 27.653 4.266 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.059 28.424 5.319 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.500 26.152 4.411 1.00 25.00 C ATOM 0 H VAL A 108 72.220 27.433 2.450 1.00 25.00 H new ATOM 0 HA VAL A 108 72.413 27.623 5.402 1.00 25.00 H new ATOM 0 HB VAL A 108 74.554 27.983 3.276 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.118 28.197 5.194 1.00 25.00 H new ATOM 0 HG12 VAL A 108 74.900 29.495 5.191 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.739 28.127 6.318 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.567 25.956 4.309 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.162 25.817 5.392 1.00 25.00 H new ATOM 0 HG23 VAL A 108 73.956 25.612 3.636 1.00 25.00 H new ATOM 456 N ARG A 109 72.103 30.100 5.318 1.00 25.00 N ATOM 457 CA ARG A 109 71.857 31.536 5.300 1.00 25.00 C ATOM 458 C ARG A 109 72.810 32.209 6.251 1.00 25.00 C ATOM 459 O ARG A 109 73.137 31.666 7.295 1.00 25.00 O ATOM 460 CB ARG A 109 70.434 31.838 5.748 1.00 25.00 C ATOM 461 CG ARG A 109 69.358 31.369 4.778 1.00 25.00 C ATOM 462 CD ARG A 109 68.496 32.540 4.344 1.00 25.00 C ATOM 463 NE ARG A 109 67.864 33.229 5.480 1.00 25.00 N ATOM 464 CZ ARG A 109 67.362 34.458 5.448 1.00 25.00 C ATOM 465 NH1 ARG A 109 67.368 35.197 4.367 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 66.841 34.947 6.538 1.00 25.00 N ATOM 0 H ARG A 109 71.966 29.664 6.230 1.00 25.00 H new ATOM 0 HA ARG A 109 72.001 31.904 4.284 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.263 31.368 6.717 1.00 25.00 H new ATOM 0 HB3 ARG A 109 70.332 32.913 5.893 1.00 25.00 H new ATOM 0 HG2 ARG A 109 69.821 30.906 3.906 1.00 25.00 H new ATOM 0 HG3 ARG A 109 68.738 30.608 5.252 1.00 25.00 H new ATOM 0 HD2 ARG A 109 69.108 33.250 3.788 1.00 25.00 H new ATOM 0 HD3 ARG A 109 67.722 32.184 3.664 1.00 25.00 H new ATOM 0 HE ARG A 109 67.807 32.722 6.363 1.00 25.00 H new ATOM 0 HH11 ARG A 109 67.770 34.833 3.503 1.00 25.00 H new ATOM 0 HH12 ARG A 109 66.971 36.136 4.389 1.00 25.00 H new ATOM 0 HH21 ARG A 109 66.825 34.388 7.391 1.00 25.00 H new ATOM 0 HH22 ARG A 109 66.449 35.889 6.538 1.00 25.00 H new ATOM 480 N ARG A 110 73.217 33.420 5.909 1.00 25.00 N ATOM 481 CA ARG A 110 74.091 34.215 6.772 1.00 25.00 C ATOM 482 C ARG A 110 73.385 34.526 8.088 1.00 25.00 C ATOM 483 O ARG A 110 74.017 34.685 9.123 1.00 25.00 O ATOM 484 CB ARG A 110 74.463 35.517 6.047 1.00 25.00 C ATOM 485 CG ARG A 110 75.539 36.350 6.742 1.00 25.00 C ATOM 486 CD ARG A 110 76.884 35.638 6.720 1.00 25.00 C ATOM 487 NE ARG A 110 77.939 36.453 7.342 1.00 25.00 N ATOM 488 CZ ARG A 110 79.199 36.069 7.511 1.00 25.00 C ATOM 489 NH1 ARG A 110 79.630 34.892 7.125 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 80.041 36.885 8.080 1.00 25.00 N ATOM 0 H ARG A 110 72.958 33.881 5.037 1.00 25.00 H new ATOM 0 HA ARG A 110 74.998 33.652 6.993 1.00 25.00 H new ATOM 0 HB2 ARG A 110 74.805 35.272 5.042 1.00 25.00 H new ATOM 0 HB3 ARG A 110 73.565 36.126 5.938 1.00 25.00 H new ATOM 0 HG2 ARG A 110 75.629 37.318 6.249 1.00 25.00 H new ATOM 0 HG3 ARG A 110 75.244 36.544 7.773 1.00 25.00 H new ATOM 0 HD2 ARG A 110 76.801 34.687 7.245 1.00 25.00 H new ATOM 0 HD3 ARG A 110 77.159 35.410 5.690 1.00 25.00 H new ATOM 0 HE ARG A 110 77.683 37.385 7.669 1.00 25.00 H new ATOM 0 HH11 ARG A 110 78.990 34.236 6.678 1.00 25.00 H new ATOM 0 HH12 ARG A 110 80.605 34.633 7.272 1.00 25.00 H new ATOM 0 HH21 ARG A 110 79.729 37.806 8.389 1.00 25.00 H new ATOM 0 HH22 ARG A 110 81.012 36.603 8.216 1.00 25.00 H new ATOM 504 N ASP A 111 72.068 34.599 8.017 1.00 25.00 N ATOM 505 CA ASP A 111 71.218 34.973 9.145 1.00 25.00 C ATOM 506 C ASP A 111 70.841 33.808 10.072 1.00 25.00 C ATOM 507 O ASP A 111 69.817 33.864 10.746 1.00 25.00 O ATOM 508 CB ASP A 111 69.949 35.605 8.576 1.00 25.00 C ATOM 509 CG ASP A 111 70.239 36.487 7.382 1.00 25.00 C ATOM 510 OD1 ASP A 111 70.688 37.635 7.568 1.00 25.00 O ATOM 511 OD2 ASP A 111 70.124 35.976 6.242 1.00 25.00 O1- ATOM 0 H ASP A 111 71.546 34.398 7.164 1.00 25.00 H new ATOM 0 HA ASP A 111 71.787 35.664 9.767 1.00 25.00 H new ATOM 0 HB2 ASP A 111 69.252 34.819 8.285 1.00 25.00 H new ATOM 0 HB3 ASP A 111 69.459 36.194 9.351 1.00 25.00 H new ATOM 516 N LEU A 112 71.668 32.764 10.084 1.00 25.00 N ATOM 517 CA LEU A 112 71.489 31.583 10.960 1.00 25.00 C ATOM 518 C LEU A 112 70.115 30.922 10.791 1.00 25.00 C ATOM 519 O LEU A 112 69.467 30.506 11.748 1.00 25.00 O ATOM 520 CB LEU A 112 71.734 31.954 12.432 1.00 25.00 C ATOM 521 CG LEU A 112 73.113 32.559 12.749 1.00 25.00 C ATOM 522 CD1 LEU A 112 73.147 33.010 14.209 1.00 25.00 C ATOM 523 CD2 LEU A 112 74.247 31.555 12.493 1.00 25.00 C ATOM 0 H LEU A 112 72.491 32.703 9.485 1.00 25.00 H new ATOM 0 HA LEU A 112 72.233 30.849 10.651 1.00 25.00 H new ATOM 0 HB2 LEU A 112 70.967 32.664 12.741 1.00 25.00 H new ATOM 0 HB3 LEU A 112 71.603 31.059 13.040 1.00 25.00 H new ATOM 0 HG LEU A 112 73.267 33.412 12.088 1.00 25.00 H new ATOM 0 HD11 LEU A 112 74.123 33.439 14.435 1.00 25.00 H new ATOM 0 HD12 LEU A 112 72.374 33.760 14.376 1.00 25.00 H new ATOM 0 HD13 LEU A 112 72.968 32.153 14.859 1.00 25.00 H new ATOM 0 HD21 LEU A 112 75.204 32.020 12.728 1.00 25.00 H new ATOM 0 HD22 LEU A 112 74.105 30.677 13.123 1.00 25.00 H new ATOM 0 HD23 LEU A 112 74.237 31.255 11.445 1.00 25.00 H new ATOM 535 N SER A 113 69.667 30.893 9.548 1.00 25.00 N ATOM 536 CA SER A 113 68.359 30.357 9.163 1.00 25.00 C ATOM 537 C SER A 113 68.446 29.001 8.469 1.00 25.00 C ATOM 538 O SER A 113 67.672 28.732 7.555 1.00 25.00 O ATOM 539 CB SER A 113 67.646 31.324 8.245 1.00 25.00 C ATOM 540 OG SER A 113 67.920 32.672 8.597 1.00 25.00 O ATOM 0 H SER A 113 70.207 31.246 8.758 1.00 25.00 H new ATOM 0 HA SER A 113 67.804 30.222 10.091 1.00 25.00 H new ATOM 0 HB2 SER A 113 67.955 31.145 7.215 1.00 25.00 H new ATOM 0 HB3 SER A 113 66.572 31.146 8.290 1.00 25.00 H new ATOM 0 HG SER A 113 67.113 33.083 8.972 1.00 25.00 H new ATOM 546 N GLU A 114 69.495 28.243 8.734 1.00 25.00 N ATOM 547 CA GLU A 114 69.825 27.099 7.883 1.00 25.00 C ATOM 548 C GLU A 114 68.845 25.937 8.071 1.00 25.00 C ATOM 549 O GLU A 114 68.310 25.713 9.155 1.00 25.00 O ATOM 550 CB GLU A 114 71.225 26.577 8.240 1.00 25.00 C ATOM 551 CG GLU A 114 72.347 27.581 8.015 1.00 25.00 C ATOM 552 CD GLU A 114 72.828 28.253 9.288 1.00 25.00 C ATOM 553 OE1 GLU A 114 71.999 28.532 10.173 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 74.038 28.565 9.367 1.00 25.00 O1- ATOM 0 H GLU A 114 70.129 28.390 9.519 1.00 25.00 H new ATOM 0 HA GLU A 114 69.774 27.448 6.852 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.230 26.273 9.287 1.00 25.00 H new ATOM 0 HB3 GLU A 114 71.428 25.685 7.648 1.00 25.00 H new ATOM 0 HG2 GLU A 114 73.188 27.073 7.543 1.00 25.00 H new ATOM 0 HG3 GLU A 114 72.004 28.346 7.318 1.00 25.00 H new ATOM 561 N VAL A 115 68.609 25.211 6.983 1.00 25.00 N ATOM 562 CA VAL A 115 67.629 24.121 6.951 1.00 25.00 C ATOM 563 C VAL A 115 68.065 23.167 5.844 1.00 25.00 C ATOM 564 O VAL A 115 68.741 23.579 4.909 1.00 25.00 O ATOM 565 CB VAL A 115 66.175 24.686 6.675 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.067 25.331 5.278 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.101 23.597 6.844 1.00 25.00 C ATOM 0 H VAL A 115 69.090 25.359 6.096 1.00 25.00 H new ATOM 0 HA VAL A 115 67.589 23.603 7.909 1.00 25.00 H new ATOM 0 HB VAL A 115 65.995 25.461 7.420 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.055 25.706 5.128 1.00 25.00 H new ATOM 0 HG12 VAL A 115 66.775 26.157 5.203 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.295 24.587 4.515 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.117 24.023 6.647 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.293 22.785 6.142 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.131 23.211 7.863 1.00 25.00 H new ATOM 577 N THR A 116 67.694 21.901 5.936 1.00 25.00 N ATOM 578 CA THR A 116 68.009 20.928 4.892 1.00 25.00 C ATOM 579 C THR A 116 66.717 20.203 4.553 1.00 25.00 C ATOM 580 O THR A 116 65.859 20.022 5.418 1.00 25.00 O ATOM 581 CB THR A 116 69.129 19.938 5.338 1.00 25.00 C ATOM 582 OG1 THR A 116 69.303 18.924 4.347 1.00 25.00 O ATOM 583 CG2 THR A 116 68.815 19.277 6.672 1.00 25.00 C ATOM 0 H THR A 116 67.172 21.518 6.724 1.00 25.00 H new ATOM 0 HA THR A 116 68.403 21.434 4.011 1.00 25.00 H new ATOM 0 HB THR A 116 70.044 20.519 5.455 1.00 25.00 H new ATOM 0 HG1 THR A 116 70.009 18.306 4.631 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.623 18.597 6.940 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.714 20.042 7.442 1.00 25.00 H new ATOM 0 HG23 THR A 116 67.883 18.718 6.591 1.00 25.00 H new ATOM 591 N PHE A 117 66.556 19.854 3.287 1.00 25.00 N ATOM 592 CA PHE A 117 65.342 19.214 2.793 1.00 25.00 C ATOM 593 C PHE A 117 65.721 18.406 1.560 1.00 25.00 C ATOM 594 O PHE A 117 66.859 18.481 1.101 1.00 25.00 O ATOM 595 CB PHE A 117 64.274 20.268 2.462 1.00 25.00 C ATOM 596 CG PHE A 117 64.745 21.341 1.516 1.00 25.00 C ATOM 597 CD1 PHE A 117 64.645 21.160 0.125 1.00 25.00 C ATOM 598 CD2 PHE A 117 65.269 22.552 2.016 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.064 22.173 -0.770 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.693 23.575 1.134 1.00 25.00 C ATOM 601 CZ PHE A 117 65.590 23.387 -0.262 1.00 25.00 C ATOM 0 H PHE A 117 67.264 20.006 2.569 1.00 25.00 H new ATOM 0 HA PHE A 117 64.915 18.558 3.552 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.408 19.769 2.027 1.00 25.00 H new ATOM 0 HB3 PHE A 117 63.940 20.736 3.388 1.00 25.00 H new ATOM 0 HD1 PHE A 117 64.243 20.236 -0.265 1.00 25.00 H new ATOM 0 HD2 PHE A 117 65.347 22.700 3.083 1.00 25.00 H new ATOM 0 HE1 PHE A 117 64.983 22.021 -1.836 1.00 25.00 H new ATOM 0 HE2 PHE A 117 66.094 24.497 1.528 1.00 25.00 H new ATOM 0 HZ PHE A 117 65.911 24.165 -0.939 1.00 25.00 H new ATOM 611 N SER A 118 64.787 17.638 1.022 1.00 25.00 N ATOM 612 CA SER A 118 65.054 16.817 -0.156 1.00 25.00 C ATOM 613 C SER A 118 64.015 17.101 -1.226 1.00 25.00 C ATOM 614 O SER A 118 62.901 17.508 -0.917 1.00 25.00 O ATOM 615 CB SER A 118 65.039 15.333 0.211 1.00 25.00 C ATOM 616 OG SER A 118 66.041 15.044 1.175 1.00 25.00 O ATOM 0 H SER A 118 63.835 17.564 1.380 1.00 25.00 H new ATOM 0 HA SER A 118 66.043 17.067 -0.541 1.00 25.00 H new ATOM 0 HB2 SER A 118 64.060 15.060 0.604 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.203 14.731 -0.683 1.00 25.00 H new ATOM 0 HG SER A 118 66.015 14.090 1.398 1.00 25.00 H new ATOM 622 N LEU A 119 64.398 16.904 -2.478 1.00 25.00 N ATOM 623 CA LEU A 119 63.536 17.178 -3.624 1.00 25.00 C ATOM 624 C LEU A 119 63.535 15.993 -4.565 1.00 25.00 C ATOM 625 O LEU A 119 64.552 15.324 -4.729 1.00 25.00 O ATOM 626 CB LEU A 119 64.055 18.391 -4.394 1.00 25.00 C ATOM 627 CG LEU A 119 63.962 19.754 -3.705 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.636 20.766 -4.600 1.00 25.00 C ATOM 629 CD2 LEU A 119 62.517 20.159 -3.456 1.00 25.00 C ATOM 0 H LEU A 119 65.319 16.548 -2.732 1.00 25.00 H new ATOM 0 HA LEU A 119 62.529 17.370 -3.254 1.00 25.00 H new ATOM 0 HB2 LEU A 119 65.101 18.210 -4.643 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.509 18.451 -5.335 1.00 25.00 H new ATOM 0 HG LEU A 119 64.452 19.703 -2.732 1.00 25.00 H new ATOM 0 HD11 LEU A 119 64.587 21.751 -4.137 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.679 20.485 -4.746 1.00 25.00 H new ATOM 0 HD13 LEU A 119 64.129 20.793 -5.565 1.00 25.00 H new ATOM 0 HD21 LEU A 119 62.491 21.132 -2.965 1.00 25.00 H new ATOM 0 HD22 LEU A 119 61.987 20.218 -4.406 1.00 25.00 H new ATOM 0 HD23 LEU A 119 62.036 19.418 -2.817 1.00 25.00 H new ATOM 641 N GLN A 120 62.404 15.767 -5.212 1.00 25.00 N ATOM 642 CA GLN A 120 62.276 14.697 -6.198 1.00 25.00 C ATOM 643 C GLN A 120 62.278 15.346 -7.574 1.00 25.00 C ATOM 644 O GLN A 120 61.520 16.282 -7.822 1.00 25.00 O ATOM 645 CB GLN A 120 60.984 13.910 -5.974 1.00 25.00 C ATOM 646 CG GLN A 120 60.858 12.677 -6.864 1.00 25.00 C ATOM 647 CD GLN A 120 59.550 11.945 -6.652 1.00 25.00 C ATOM 648 OE1 GLN A 120 59.152 11.674 -5.534 1.00 25.00 O ATOM 649 NE2 GLN A 120 58.874 11.633 -7.727 1.00 25.00 N ATOM 0 H GLN A 120 61.553 16.312 -5.073 1.00 25.00 H new ATOM 0 HA GLN A 120 63.103 13.992 -6.107 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.933 13.601 -4.930 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.133 14.566 -6.154 1.00 25.00 H new ATOM 0 HG2 GLN A 120 60.939 12.976 -7.909 1.00 25.00 H new ATOM 0 HG3 GLN A 120 61.688 12.000 -6.662 1.00 25.00 H new ATOM 0 HE21 GLN A 120 59.239 11.876 -8.648 1.00 25.00 H new ATOM 0 HE22 GLN A 120 57.981 11.146 -7.645 1.00 25.00 H new ATOM 658 N VAL A 121 63.168 14.886 -8.438 1.00 25.00 N ATOM 659 CA VAL A 121 63.373 15.485 -9.759 1.00 25.00 C ATOM 660 C VAL A 121 63.599 14.381 -10.789 1.00 25.00 C ATOM 661 O VAL A 121 63.874 13.247 -10.421 1.00 25.00 O ATOM 662 CB VAL A 121 64.628 16.417 -9.738 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.368 17.657 -8.885 1.00 25.00 C ATOM 664 CG2 VAL A 121 65.854 15.673 -9.185 1.00 25.00 C ATOM 0 H VAL A 121 63.772 14.086 -8.249 1.00 25.00 H new ATOM 0 HA VAL A 121 62.490 16.068 -10.021 1.00 25.00 H new ATOM 0 HB VAL A 121 64.827 16.722 -10.765 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.255 18.291 -8.885 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.525 18.212 -9.297 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.138 17.354 -7.863 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.714 16.342 -9.180 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.649 15.339 -8.168 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.070 14.809 -9.814 1.00 25.00 H new ATOM 674 N ASP A 122 63.512 14.714 -12.069 1.00 25.00 N ATOM 675 CA ASP A 122 63.871 13.773 -13.141 1.00 25.00 C ATOM 676 C ASP A 122 65.395 13.850 -13.260 1.00 25.00 C ATOM 677 O ASP A 122 66.000 14.848 -12.878 1.00 25.00 O ATOM 678 CB ASP A 122 63.196 14.182 -14.472 1.00 25.00 C ATOM 679 CG ASP A 122 63.187 13.048 -15.533 1.00 25.00 C ATOM 680 OD1 ASP A 122 64.265 12.505 -15.883 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 62.099 12.747 -16.059 1.00 25.00 O1- ATOM 0 H ASP A 122 63.197 15.626 -12.399 1.00 25.00 H new ATOM 0 HA ASP A 122 63.536 12.760 -12.919 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.170 14.489 -14.271 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.714 15.049 -14.882 1.00 25.00 H new ATOM 686 N ALA A 123 66.013 12.830 -13.828 1.00 25.00 N ATOM 687 CA ALA A 123 67.442 12.855 -14.096 1.00 25.00 C ATOM 688 C ALA A 123 67.747 13.998 -15.077 1.00 25.00 C ATOM 689 O ALA A 123 68.788 14.658 -14.995 1.00 25.00 O ATOM 690 CB ALA A 123 67.873 11.504 -14.684 1.00 25.00 C ATOM 0 H ALA A 123 65.546 11.970 -14.114 1.00 25.00 H new ATOM 0 HA ALA A 123 67.997 13.024 -13.173 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.944 11.520 -14.886 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.650 10.709 -13.972 1.00 25.00 H new ATOM 0 HB3 ALA A 123 67.332 11.322 -15.612 1.00 25.00 H new ATOM 696 N ASP A 124 66.818 14.227 -15.996 1.00 25.00 N ATOM 697 CA ASP A 124 66.988 15.239 -17.041 1.00 25.00 C ATOM 698 C ASP A 124 66.447 16.620 -16.635 1.00 25.00 C ATOM 699 O ASP A 124 66.282 17.507 -17.464 1.00 25.00 O ATOM 700 CB ASP A 124 66.296 14.765 -18.323 1.00 25.00 C ATOM 701 CG ASP A 124 66.987 15.267 -19.589 1.00 25.00 C ATOM 702 OD1 ASP A 124 68.145 15.746 -19.507 1.00 25.00 O ATOM 703 OD2 ASP A 124 66.414 15.068 -20.680 1.00 25.00 O1- ATOM 0 H ASP A 124 65.932 13.724 -16.042 1.00 25.00 H new ATOM 0 HA ASP A 124 68.059 15.358 -17.205 1.00 25.00 H new ATOM 0 HB2 ASP A 124 66.272 13.675 -18.336 1.00 25.00 H new ATOM 0 HB3 ASP A 124 65.261 15.107 -18.320 1.00 25.00 H new ATOM 708 N PHE A 125 66.157 16.797 -15.354 1.00 25.00 N ATOM 709 CA PHE A 125 65.647 18.075 -14.851 1.00 25.00 C ATOM 710 C PHE A 125 66.761 19.117 -14.964 1.00 25.00 C ATOM 711 O PHE A 125 67.905 18.843 -14.608 1.00 25.00 O ATOM 712 CB PHE A 125 65.221 17.899 -13.391 1.00 25.00 C ATOM 713 CG PHE A 125 64.191 18.887 -12.910 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.902 18.910 -13.476 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.476 19.754 -11.838 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.905 19.789 -12.978 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.482 20.627 -11.327 1.00 25.00 C ATOM 718 CZ PHE A 125 62.200 20.643 -11.896 1.00 25.00 C ATOM 0 H PHE A 125 66.264 16.076 -14.641 1.00 25.00 H new ATOM 0 HA PHE A 125 64.785 18.406 -15.430 1.00 25.00 H new ATOM 0 HB2 PHE A 125 64.826 16.891 -13.261 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.104 17.979 -12.757 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.669 18.251 -14.299 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.463 19.754 -11.400 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.923 19.803 -13.427 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.712 21.280 -10.499 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.442 21.307 -11.507 1.00 25.00 H new ATOM 728 N GLU A 126 66.438 20.297 -15.472 1.00 25.00 N ATOM 729 CA GLU A 126 67.434 21.361 -15.637 1.00 25.00 C ATOM 730 C GLU A 126 67.885 21.894 -14.290 1.00 25.00 C ATOM 731 O GLU A 126 67.081 22.004 -13.363 1.00 25.00 O ATOM 732 CB GLU A 126 66.837 22.558 -16.373 1.00 25.00 C ATOM 733 CG GLU A 126 66.422 22.320 -17.799 1.00 25.00 C ATOM 734 CD GLU A 126 65.798 23.575 -18.387 1.00 25.00 C ATOM 735 OE1 GLU A 126 66.463 24.636 -18.363 1.00 25.00 O ATOM 736 OE2 GLU A 126 64.604 23.531 -18.756 1.00 25.00 O1- ATOM 0 H GLU A 126 65.498 20.548 -15.778 1.00 25.00 H new ATOM 0 HA GLU A 126 68.262 20.922 -16.193 1.00 25.00 H new ATOM 0 HB2 GLU A 126 65.966 22.904 -15.816 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.567 23.368 -16.359 1.00 25.00 H new ATOM 0 HG2 GLU A 126 67.288 22.025 -18.392 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.709 21.497 -17.844 1.00 25.00 H new ATOM 743 N LEU A 127 69.122 22.361 -14.217 1.00 25.00 N ATOM 744 CA LEU A 127 69.603 23.059 -13.026 1.00 25.00 C ATOM 745 C LEU A 127 68.785 24.332 -12.819 1.00 25.00 C ATOM 746 O LEU A 127 68.510 24.730 -11.691 1.00 25.00 O ATOM 747 CB LEU A 127 71.066 23.449 -13.201 1.00 25.00 C ATOM 748 CG LEU A 127 72.005 23.298 -12.000 1.00 25.00 C ATOM 749 CD1 LEU A 127 73.359 23.859 -12.403 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.516 24.021 -10.739 1.00 25.00 C ATOM 0 H LEU A 127 69.812 22.272 -14.963 1.00 25.00 H new ATOM 0 HA LEU A 127 69.500 22.397 -12.167 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.473 22.854 -14.019 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.097 24.491 -13.519 1.00 25.00 H new ATOM 0 HG LEU A 127 72.051 22.239 -11.744 1.00 25.00 H new ATOM 0 HD11 LEU A 127 74.054 23.767 -11.568 1.00 25.00 H new ATOM 0 HD12 LEU A 127 73.743 23.303 -13.258 1.00 25.00 H new ATOM 0 HD13 LEU A 127 73.252 24.910 -12.672 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.232 23.869 -9.931 1.00 25.00 H new ATOM 0 HD22 LEU A 127 71.422 25.087 -10.944 1.00 25.00 H new ATOM 0 HD23 LEU A 127 70.546 23.621 -10.444 1.00 25.00 H new ATOM 762 N HIS A 128 68.386 24.963 -13.914 1.00 25.00 N ATOM 763 CA HIS A 128 67.588 26.185 -13.856 1.00 25.00 C ATOM 764 C HIS A 128 66.274 25.936 -13.119 1.00 25.00 C ATOM 765 O HIS A 128 65.865 26.722 -12.268 1.00 25.00 O ATOM 766 CB HIS A 128 67.302 26.693 -15.274 1.00 25.00 C ATOM 767 CG HIS A 128 66.828 28.111 -15.316 1.00 25.00 C ATOM 768 ND1 HIS A 128 65.564 28.521 -14.971 1.00 25.00 N ATOM 769 CD2 HIS A 128 67.481 29.250 -15.677 1.00 25.00 C ATOM 770 CE1 HIS A 128 65.499 29.840 -15.121 1.00 25.00 C ATOM 771 NE2 HIS A 128 66.643 30.339 -15.545 1.00 25.00 N ATOM 0 H HIS A 128 68.602 24.649 -14.860 1.00 25.00 H new ATOM 0 HA HIS A 128 68.154 26.941 -13.311 1.00 25.00 H new ATOM 0 HB2 HIS A 128 68.208 26.603 -15.873 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.550 26.053 -15.736 1.00 25.00 H new ATOM 0 HD2 HIS A 128 68.505 29.295 -16.017 1.00 25.00 H new ATOM 0 HE1 HIS A 128 64.617 30.430 -14.920 1.00 25.00 H new ATOM 0 HE2 HIS A 128 66.862 31.317 -15.734 1.00 25.00 H new ATOM 779 N ASN A 129 65.629 24.820 -13.418 1.00 25.00 N ATOM 780 CA ASN A 129 64.375 24.483 -12.758 1.00 25.00 C ATOM 781 C ASN A 129 64.641 23.936 -11.359 1.00 25.00 C ATOM 782 O ASN A 129 63.865 24.164 -10.449 1.00 25.00 O ATOM 783 CB ASN A 129 63.583 23.478 -13.596 1.00 25.00 C ATOM 784 CG ASN A 129 63.079 24.081 -14.881 1.00 25.00 C ATOM 785 OD1 ASN A 129 62.546 25.177 -14.887 1.00 25.00 O ATOM 786 ND2 ASN A 129 63.274 23.393 -15.970 1.00 25.00 N ATOM 0 H ASN A 129 65.947 24.137 -14.106 1.00 25.00 H new ATOM 0 HA ASN A 129 63.777 25.389 -12.661 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.215 22.619 -13.823 1.00 25.00 H new ATOM 0 HB3 ASN A 129 62.739 23.108 -13.014 1.00 25.00 H new ATOM 0 HD21 ASN A 129 62.977 23.768 -16.871 1.00 25.00 H new ATOM 0 HD22 ASN A 129 63.724 22.479 -15.922 1.00 25.00 H new ATOM 793 N PHE A 130 65.759 23.252 -11.177 1.00 25.00 N ATOM 794 CA PHE A 130 66.134 22.711 -9.868 1.00 25.00 C ATOM 795 C PHE A 130 66.370 23.809 -8.842 1.00 25.00 C ATOM 796 O PHE A 130 65.903 23.720 -7.710 1.00 25.00 O ATOM 797 CB PHE A 130 67.405 21.876 -10.008 1.00 25.00 C ATOM 798 CG PHE A 130 67.838 21.202 -8.732 1.00 25.00 C ATOM 799 CD1 PHE A 130 66.964 20.345 -8.039 1.00 25.00 C ATOM 800 CD2 PHE A 130 69.137 21.403 -8.230 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.383 19.680 -6.861 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.568 20.745 -7.054 1.00 25.00 C ATOM 803 CZ PHE A 130 68.690 19.879 -6.369 1.00 25.00 C ATOM 0 H PHE A 130 66.430 23.054 -11.920 1.00 25.00 H new ATOM 0 HA PHE A 130 65.306 22.095 -9.517 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.246 21.116 -10.773 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.212 22.518 -10.360 1.00 25.00 H new ATOM 0 HD1 PHE A 130 65.961 20.192 -8.410 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.813 22.067 -8.748 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.703 19.022 -6.340 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.569 20.906 -6.681 1.00 25.00 H new ATOM 0 HZ PHE A 130 69.016 19.371 -5.473 1.00 25.00 H new ATOM 813 N ARG A 131 67.082 24.858 -9.229 1.00 25.00 N ATOM 814 CA ARG A 131 67.353 25.946 -8.294 1.00 25.00 C ATOM 815 C ARG A 131 66.075 26.727 -7.994 1.00 25.00 C ATOM 816 O ARG A 131 65.908 27.213 -6.897 1.00 25.00 O ATOM 817 CB ARG A 131 68.497 26.852 -8.780 1.00 25.00 C ATOM 818 CG ARG A 131 68.193 27.725 -9.995 1.00 25.00 C ATOM 819 CD ARG A 131 69.462 28.410 -10.502 1.00 25.00 C ATOM 820 NE ARG A 131 70.024 29.356 -9.517 1.00 25.00 N ATOM 821 CZ ARG A 131 71.278 29.797 -9.503 1.00 25.00 C ATOM 822 NH1 ARG A 131 72.167 29.414 -10.386 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 71.651 30.642 -8.582 1.00 25.00 N ATOM 0 H ARG A 131 67.476 24.981 -10.162 1.00 25.00 H new ATOM 0 HA ARG A 131 67.696 25.508 -7.357 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.794 27.502 -7.956 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.356 26.224 -9.015 1.00 25.00 H new ATOM 0 HG2 ARG A 131 67.762 27.114 -10.788 1.00 25.00 H new ATOM 0 HG3 ARG A 131 67.449 28.477 -9.731 1.00 25.00 H new ATOM 0 HD2 ARG A 131 70.209 27.653 -10.742 1.00 25.00 H new ATOM 0 HD3 ARG A 131 69.239 28.942 -11.427 1.00 25.00 H new ATOM 0 HE ARG A 131 69.399 29.699 -8.788 1.00 25.00 H new ATOM 0 HH11 ARG A 131 71.907 28.754 -11.119 1.00 25.00 H new ATOM 0 HH12 ARG A 131 73.120 29.776 -10.341 1.00 25.00 H new ATOM 0 HH21 ARG A 131 70.982 30.959 -7.880 1.00 25.00 H new ATOM 0 HH22 ARG A 131 72.611 30.986 -8.564 1.00 25.00 H new ATOM 837 N ALA A 132 65.144 26.774 -8.937 1.00 25.00 N ATOM 838 CA ALA A 132 63.849 27.407 -8.684 1.00 25.00 C ATOM 839 C ALA A 132 63.027 26.531 -7.723 1.00 25.00 C ATOM 840 O ALA A 132 62.346 27.025 -6.832 1.00 25.00 O ATOM 841 CB ALA A 132 63.096 27.610 -10.007 1.00 25.00 C ATOM 0 H ALA A 132 65.255 26.388 -9.874 1.00 25.00 H new ATOM 0 HA ALA A 132 64.006 28.383 -8.224 1.00 25.00 H new ATOM 0 HB1 ALA A 132 62.133 28.082 -9.809 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.684 28.248 -10.666 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.935 26.644 -10.486 1.00 25.00 H new ATOM 847 N LEU A 133 63.120 25.221 -7.905 1.00 25.00 N ATOM 848 CA LEU A 133 62.403 24.265 -7.066 1.00 25.00 C ATOM 849 C LEU A 133 62.903 24.317 -5.620 1.00 25.00 C ATOM 850 O LEU A 133 62.120 24.238 -4.686 1.00 25.00 O ATOM 851 CB LEU A 133 62.574 22.851 -7.646 1.00 25.00 C ATOM 852 CG LEU A 133 61.663 21.741 -7.096 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.198 22.003 -7.429 1.00 25.00 C ATOM 854 CD2 LEU A 133 62.082 20.398 -7.697 1.00 25.00 C ATOM 0 H LEU A 133 63.690 24.791 -8.633 1.00 25.00 H new ATOM 0 HA LEU A 133 61.345 24.528 -7.058 1.00 25.00 H new ATOM 0 HB2 LEU A 133 62.420 22.909 -8.723 1.00 25.00 H new ATOM 0 HB3 LEU A 133 63.608 22.546 -7.488 1.00 25.00 H new ATOM 0 HG LEU A 133 61.769 21.723 -6.011 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.584 21.199 -7.025 1.00 25.00 H new ATOM 0 HD12 LEU A 133 59.889 22.951 -6.990 1.00 25.00 H new ATOM 0 HD13 LEU A 133 60.073 22.047 -8.511 1.00 25.00 H new ATOM 0 HD21 LEU A 133 61.438 19.609 -7.309 1.00 25.00 H new ATOM 0 HD22 LEU A 133 61.990 20.441 -8.782 1.00 25.00 H new ATOM 0 HD23 LEU A 133 63.117 20.186 -7.429 1.00 25.00 H new ATOM 866 N CYS A 134 64.205 24.485 -5.425 1.00 25.00 N ATOM 867 CA CYS A 134 64.740 24.587 -4.068 1.00 25.00 C ATOM 868 C CYS A 134 64.488 25.972 -3.468 1.00 25.00 C ATOM 869 O CYS A 134 64.404 26.115 -2.253 1.00 25.00 O ATOM 870 CB CYS A 134 66.226 24.210 -4.021 1.00 25.00 C ATOM 871 SG CYS A 134 67.368 25.430 -4.688 1.00 25.00 S ATOM 0 H CYS A 134 64.899 24.553 -6.169 1.00 25.00 H new ATOM 0 HA CYS A 134 64.204 23.866 -3.450 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.499 24.014 -2.984 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.362 23.277 -4.568 1.00 25.00 H new ATOM 0 HG CYS A 134 66.744 26.188 -5.540 1.00 25.00 H new ATOM 877 N GLU A 135 64.340 26.982 -4.314 1.00 25.00 N ATOM 878 CA GLU A 135 64.006 28.334 -3.858 1.00 25.00 C ATOM 879 C GLU A 135 62.614 28.323 -3.223 1.00 25.00 C ATOM 880 O GLU A 135 62.388 28.962 -2.197 1.00 25.00 O ATOM 881 CB GLU A 135 64.096 29.319 -5.039 1.00 25.00 C ATOM 882 CG GLU A 135 63.043 30.436 -5.091 1.00 25.00 C ATOM 883 CD GLU A 135 63.342 31.460 -6.191 1.00 25.00 C ATOM 884 OE1 GLU A 135 64.386 31.325 -6.881 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 62.592 32.448 -6.310 1.00 25.00 O1- ATOM 0 H GLU A 135 64.445 26.895 -5.325 1.00 25.00 H new ATOM 0 HA GLU A 135 64.717 28.665 -3.102 1.00 25.00 H new ATOM 0 HB2 GLU A 135 65.082 29.783 -5.020 1.00 25.00 H new ATOM 0 HB3 GLU A 135 64.030 28.747 -5.964 1.00 25.00 H new ATOM 0 HG2 GLU A 135 62.059 29.998 -5.261 1.00 25.00 H new ATOM 0 HG3 GLU A 135 63.004 30.942 -4.126 1.00 25.00 H new ATOM 892 N LEU A 136 61.712 27.531 -3.791 1.00 25.00 N ATOM 893 CA LEU A 136 60.354 27.406 -3.263 1.00 25.00 C ATOM 894 C LEU A 136 60.351 26.877 -1.828 1.00 25.00 C ATOM 895 O LEU A 136 59.655 27.405 -0.967 1.00 25.00 O ATOM 896 CB LEU A 136 59.543 26.458 -4.157 1.00 25.00 C ATOM 897 CG LEU A 136 58.057 26.272 -3.805 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.258 27.559 -4.039 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.480 25.140 -4.653 1.00 25.00 C ATOM 0 H LEU A 136 61.895 26.964 -4.619 1.00 25.00 H new ATOM 0 HA LEU A 136 59.904 28.399 -3.257 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.606 26.822 -5.183 1.00 25.00 H new ATOM 0 HB3 LEU A 136 60.022 25.479 -4.136 1.00 25.00 H new ATOM 0 HG LEU A 136 57.981 26.024 -2.746 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.213 27.391 -3.780 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.662 28.357 -3.416 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.330 27.846 -5.088 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.427 25.003 -4.408 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.578 25.391 -5.709 1.00 25.00 H new ATOM 0 HD23 LEU A 136 58.023 24.218 -4.447 1.00 25.00 H new ATOM 911 N GLU A 137 61.127 25.834 -1.580 1.00 25.00 N ATOM 912 CA GLU A 137 61.161 25.202 -0.258 1.00 25.00 C ATOM 913 C GLU A 137 61.982 26.005 0.752 1.00 25.00 C ATOM 914 O GLU A 137 61.709 25.983 1.949 1.00 25.00 O ATOM 915 CB GLU A 137 61.761 23.798 -0.365 1.00 25.00 C ATOM 916 CG GLU A 137 60.995 22.854 -1.284 1.00 25.00 C ATOM 917 CD GLU A 137 59.539 22.669 -0.874 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.287 22.299 0.294 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 58.649 22.856 -1.733 1.00 25.00 O1- ATOM 0 H GLU A 137 61.742 25.404 -2.270 1.00 25.00 H new ATOM 0 HA GLU A 137 60.131 25.158 0.096 1.00 25.00 H new ATOM 0 HB2 GLU A 137 62.787 23.881 -0.723 1.00 25.00 H new ATOM 0 HB3 GLU A 137 61.806 23.358 0.631 1.00 25.00 H new ATOM 0 HG2 GLU A 137 61.033 23.239 -2.303 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.490 21.883 -1.291 1.00 25.00 H new ATOM 926 N SER A 138 63.007 26.698 0.276 1.00 25.00 N ATOM 927 CA SER A 138 63.879 27.468 1.168 1.00 25.00 C ATOM 928 C SER A 138 63.304 28.851 1.467 1.00 25.00 C ATOM 929 O SER A 138 63.683 29.482 2.455 1.00 25.00 O ATOM 930 CB SER A 138 65.274 27.607 0.561 1.00 25.00 C ATOM 931 OG SER A 138 65.227 28.271 -0.686 1.00 25.00 O ATOM 0 H SER A 138 63.258 26.747 -0.711 1.00 25.00 H new ATOM 0 HA SER A 138 63.947 26.921 2.108 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.918 28.159 1.246 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.718 26.620 0.433 1.00 25.00 H new ATOM 0 HG SER A 138 64.977 27.633 -1.387 1.00 25.00 H new ATOM 937 N GLY A 139 62.394 29.318 0.624 1.00 25.00 N ATOM 938 CA GLY A 139 61.731 30.591 0.857 1.00 25.00 C ATOM 939 C GLY A 139 62.573 31.797 0.494 1.00 25.00 C ATOM 940 O GLY A 139 62.232 32.924 0.860 1.00 25.00 O ATOM 0 H GLY A 139 62.099 28.835 -0.225 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.806 30.619 0.280 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.453 30.658 1.909 1.00 25.00 H new ATOM 944 N ILE A 140 63.679 31.577 -0.206 1.00 25.00 N ATOM 945 CA ILE A 140 64.578 32.664 -0.599 1.00 25.00 C ATOM 946 C ILE A 140 64.946 32.551 -2.079 1.00 25.00 C ATOM 947 O ILE A 140 65.060 31.447 -2.611 1.00 25.00 O ATOM 948 CB ILE A 140 65.878 32.673 0.256 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.561 31.290 0.248 1.00 25.00 C ATOM 950 CG2 ILE A 140 65.560 33.099 1.707 1.00 25.00 C ATOM 951 CD1 ILE A 140 68.032 31.332 0.584 1.00 25.00 C ATOM 0 H ILE A 140 63.979 30.653 -0.516 1.00 25.00 H new ATOM 0 HA ILE A 140 64.045 33.599 -0.426 1.00 25.00 H new ATOM 0 HB ILE A 140 66.566 33.394 -0.186 1.00 25.00 H new ATOM 0 HG12 ILE A 140 66.054 30.641 0.962 1.00 25.00 H new ATOM 0 HG13 ILE A 140 66.436 30.840 -0.737 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.478 33.101 2.295 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.127 34.099 1.706 1.00 25.00 H new ATOM 0 HG23 ILE A 140 64.850 32.397 2.145 1.00 25.00 H new ATOM 0 HD11 ILE A 140 68.440 30.322 0.558 1.00 25.00 H new ATOM 0 HD12 ILE A 140 68.554 31.953 -0.144 1.00 25.00 H new ATOM 0 HD13 ILE A 140 68.166 31.751 1.581 1.00 25.00 H new ATOM 963 N PRO A 141 65.121 33.694 -2.771 1.00 25.00 N ATOM 964 CA PRO A 141 65.427 33.562 -4.199 1.00 25.00 C ATOM 965 C PRO A 141 66.754 32.872 -4.500 1.00 25.00 C ATOM 966 O PRO A 141 67.807 33.221 -3.948 1.00 25.00 O ATOM 967 CB PRO A 141 65.472 35.019 -4.681 1.00 25.00 C ATOM 968 CG PRO A 141 64.681 35.774 -3.678 1.00 25.00 C ATOM 969 CD PRO A 141 65.017 35.112 -2.381 1.00 25.00 C ATOM 0 HA PRO A 141 64.687 32.933 -4.695 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.497 35.386 -4.735 1.00 25.00 H new ATOM 0 HB3 PRO A 141 65.045 35.119 -5.679 1.00 25.00 H new ATOM 0 HG2 PRO A 141 64.951 36.830 -3.669 1.00 25.00 H new ATOM 0 HG3 PRO A 141 63.613 35.720 -3.889 1.00 25.00 H new ATOM 0 HD2 PRO A 141 65.950 35.488 -1.962 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.243 35.272 -1.630 1.00 25.00 H new ATOM 977 N ALA A 142 66.722 31.940 -5.442 1.00 25.00 N ATOM 978 CA ALA A 142 67.925 31.270 -5.910 1.00 25.00 C ATOM 979 C ALA A 142 68.844 32.283 -6.593 1.00 25.00 C ATOM 980 O ALA A 142 70.049 32.085 -6.684 1.00 25.00 O ATOM 981 CB ALA A 142 67.559 30.153 -6.868 1.00 25.00 C ATOM 0 H ALA A 142 65.866 31.629 -5.901 1.00 25.00 H new ATOM 0 HA ALA A 142 68.450 30.835 -5.060 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.467 29.657 -7.213 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.922 29.430 -6.358 1.00 25.00 H new ATOM 0 HB3 ALA A 142 67.025 30.567 -7.723 1.00 25.00 H new ATOM 987 N ALA A 143 68.252 33.360 -7.091 1.00 25.00 N ATOM 988 CA ALA A 143 68.993 34.420 -7.768 1.00 25.00 C ATOM 989 C ALA A 143 69.900 35.199 -6.802 1.00 25.00 C ATOM 990 O ALA A 143 70.902 35.775 -7.212 1.00 25.00 O ATOM 991 CB ALA A 143 68.003 35.377 -8.444 1.00 25.00 C ATOM 0 H ALA A 143 67.247 33.525 -7.038 1.00 25.00 H new ATOM 0 HA ALA A 143 69.638 33.956 -8.514 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.552 36.170 -8.951 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.405 34.828 -9.171 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.347 35.814 -7.691 1.00 25.00 H new ATOM 997 N GLU A 144 69.537 35.220 -5.528 1.00 25.00 N ATOM 998 CA GLU A 144 70.282 35.976 -4.514 1.00 25.00 C ATOM 999 C GLU A 144 71.270 35.075 -3.777 1.00 25.00 C ATOM 1000 O GLU A 144 71.848 35.461 -2.762 1.00 25.00 O ATOM 1001 CB GLU A 144 69.308 36.576 -3.498 1.00 25.00 C ATOM 1002 CG GLU A 144 68.391 37.644 -4.074 1.00 25.00 C ATOM 1003 CD GLU A 144 67.449 38.217 -3.023 1.00 25.00 C ATOM 1004 OE1 GLU A 144 67.435 37.699 -1.882 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 66.719 39.177 -3.338 1.00 25.00 O1- ATOM 0 H GLU A 144 68.726 34.720 -5.163 1.00 25.00 H new ATOM 0 HA GLU A 144 70.834 36.768 -5.020 1.00 25.00 H new ATOM 0 HB2 GLU A 144 68.698 35.776 -3.079 1.00 25.00 H new ATOM 0 HB3 GLU A 144 69.878 37.007 -2.675 1.00 25.00 H new ATOM 0 HG2 GLU A 144 68.993 38.448 -4.498 1.00 25.00 H new ATOM 0 HG3 GLU A 144 67.807 37.218 -4.890 1.00 25.00 H new ATOM 1012 N SER A 145 71.438 33.859 -4.269 1.00 25.00 N ATOM 1013 CA SER A 145 72.278 32.875 -3.605 1.00 25.00 C ATOM 1014 C SER A 145 73.131 32.112 -4.611 1.00 25.00 C ATOM 1015 O SER A 145 72.994 32.277 -5.824 1.00 25.00 O ATOM 1016 CB SER A 145 71.387 31.919 -2.816 1.00 25.00 C ATOM 1017 OG SER A 145 70.423 31.324 -3.658 1.00 25.00 O ATOM 0 H SER A 145 71.002 33.528 -5.130 1.00 25.00 H new ATOM 0 HA SER A 145 72.960 33.386 -2.925 1.00 25.00 H new ATOM 0 HB2 SER A 145 71.998 31.145 -2.351 1.00 25.00 H new ATOM 0 HB3 SER A 145 70.889 32.459 -2.011 1.00 25.00 H new ATOM 0 HG SER A 145 69.618 31.882 -3.679 1.00 25.00 H new ATOM 1023 N GLN A 146 74.045 31.299 -4.103 1.00 25.00 N ATOM 1024 CA GLN A 146 74.942 30.508 -4.942 1.00 25.00 C ATOM 1025 C GLN A 146 74.815 29.054 -4.536 1.00 25.00 C ATOM 1026 O GLN A 146 74.735 28.749 -3.353 1.00 25.00 O ATOM 1027 CB GLN A 146 76.388 30.981 -4.761 1.00 25.00 C ATOM 1028 CG GLN A 146 76.643 32.393 -5.286 1.00 25.00 C ATOM 1029 CD GLN A 146 76.607 32.458 -6.799 1.00 25.00 C ATOM 1030 OE1 GLN A 146 77.531 32.022 -7.464 1.00 25.00 O ATOM 1031 NE2 GLN A 146 75.545 32.988 -7.346 1.00 25.00 N ATOM 0 H GLN A 146 74.188 31.167 -3.102 1.00 25.00 H new ATOM 0 HA GLN A 146 74.673 30.628 -5.992 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.643 30.945 -3.702 1.00 25.00 H new ATOM 0 HB3 GLN A 146 77.055 30.287 -5.273 1.00 25.00 H new ATOM 0 HG2 GLN A 146 75.894 33.071 -4.877 1.00 25.00 H new ATOM 0 HG3 GLN A 146 77.614 32.740 -4.932 1.00 25.00 H new ATOM 0 HE21 GLN A 146 74.791 33.343 -6.757 1.00 25.00 H new ATOM 0 HE22 GLN A 146 75.470 33.047 -8.362 1.00 25.00 H new ATOM 1040 N ILE A 147 74.780 28.163 -5.514 1.00 25.00 N ATOM 1041 CA ILE A 147 74.619 26.733 -5.255 1.00 25.00 C ATOM 1042 C ILE A 147 75.954 26.020 -5.512 1.00 25.00 C ATOM 1043 O ILE A 147 76.654 26.281 -6.498 1.00 25.00 O ATOM 1044 CB ILE A 147 73.440 26.143 -6.103 1.00 25.00 C ATOM 1045 CG1 ILE A 147 73.293 24.633 -5.818 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.639 26.461 -7.603 1.00 25.00 C ATOM 1047 CD1 ILE A 147 72.101 23.953 -6.521 1.00 25.00 C ATOM 0 H ILE A 147 74.861 28.403 -6.502 1.00 25.00 H new ATOM 0 HA ILE A 147 74.351 26.571 -4.211 1.00 25.00 H new ATOM 0 HB ILE A 147 72.502 26.616 -5.811 1.00 25.00 H new ATOM 0 HG12 ILE A 147 74.211 24.130 -6.122 1.00 25.00 H new ATOM 0 HG13 ILE A 147 73.192 24.489 -4.742 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.811 26.044 -8.176 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.671 27.541 -7.745 1.00 25.00 H new ATOM 0 HG23 ILE A 147 74.576 26.022 -7.947 1.00 25.00 H new ATOM 0 HD11 ILE A 147 72.080 22.895 -6.260 1.00 25.00 H new ATOM 0 HD12 ILE A 147 71.172 24.424 -6.200 1.00 25.00 H new ATOM 0 HD13 ILE A 147 72.207 24.059 -7.601 1.00 25.00 H new ATOM 1059 N VAL A 148 76.329 25.181 -4.562 1.00 25.00 N ATOM 1060 CA VAL A 148 77.616 24.494 -4.545 1.00 25.00 C ATOM 1061 C VAL A 148 77.383 22.984 -4.510 1.00 25.00 C ATOM 1062 O VAL A 148 76.535 22.503 -3.768 1.00 25.00 O ATOM 1063 CB VAL A 148 78.426 24.936 -3.279 1.00 25.00 C ATOM 1064 CG1 VAL A 148 79.788 24.249 -3.210 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.627 26.464 -3.284 1.00 25.00 C ATOM 0 H VAL A 148 75.738 24.951 -3.763 1.00 25.00 H new ATOM 0 HA VAL A 148 78.182 24.751 -5.441 1.00 25.00 H new ATOM 0 HB VAL A 148 77.849 24.640 -2.403 1.00 25.00 H new ATOM 0 HG11 VAL A 148 80.319 24.582 -2.318 1.00 25.00 H new ATOM 0 HG12 VAL A 148 79.649 23.169 -3.167 1.00 25.00 H new ATOM 0 HG13 VAL A 148 80.370 24.505 -4.095 1.00 25.00 H new ATOM 0 HG21 VAL A 148 79.191 26.760 -2.399 1.00 25.00 H new ATOM 0 HG22 VAL A 148 79.176 26.756 -4.179 1.00 25.00 H new ATOM 0 HG23 VAL A 148 77.656 26.959 -3.277 1.00 25.00 H new ATOM 1075 N TYR A 149 78.151 22.245 -5.295 1.00 25.00 N ATOM 1076 CA TYR A 149 78.072 20.788 -5.343 1.00 25.00 C ATOM 1077 C TYR A 149 79.495 20.251 -5.408 1.00 25.00 C ATOM 1078 O TYR A 149 80.322 20.809 -6.121 1.00 25.00 O ATOM 1079 CB TYR A 149 77.300 20.359 -6.585 1.00 25.00 C ATOM 1080 CG TYR A 149 77.385 18.880 -6.872 1.00 25.00 C ATOM 1081 CD1 TYR A 149 77.081 17.924 -5.879 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.783 18.421 -8.144 1.00 25.00 C ATOM 1083 CE1 TYR A 149 77.177 16.540 -6.157 1.00 25.00 C ATOM 1084 CE2 TYR A 149 77.867 17.037 -8.423 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.563 16.107 -7.428 1.00 25.00 C ATOM 1086 OH TYR A 149 77.637 14.769 -7.717 1.00 25.00 O ATOM 0 H TYR A 149 78.852 22.639 -5.922 1.00 25.00 H new ATOM 0 HA TYR A 149 77.558 20.400 -4.464 1.00 25.00 H new ATOM 0 HB2 TYR A 149 76.253 20.637 -6.465 1.00 25.00 H new ATOM 0 HB3 TYR A 149 77.679 20.909 -7.446 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.772 18.252 -4.898 1.00 25.00 H new ATOM 0 HD2 TYR A 149 78.027 19.136 -8.916 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.952 15.818 -5.386 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.166 16.700 -9.405 1.00 25.00 H new ATOM 0 HH TYR A 149 77.040 14.272 -7.119 1.00 25.00 H new ATOM 1096 N ALA A 150 79.789 19.217 -4.624 1.00 25.00 N ATOM 1097 CA ALA A 150 81.144 18.652 -4.519 1.00 25.00 C ATOM 1098 C ALA A 150 82.170 19.767 -4.223 1.00 25.00 C ATOM 1099 O ALA A 150 83.243 19.820 -4.816 1.00 25.00 O ATOM 1100 CB ALA A 150 81.506 17.879 -5.808 1.00 25.00 C ATOM 0 H ALA A 150 79.099 18.743 -4.041 1.00 25.00 H new ATOM 0 HA ALA A 150 81.169 17.946 -3.689 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.511 17.467 -5.715 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.794 17.068 -5.958 1.00 25.00 H new ATOM 0 HB3 ALA A 150 81.469 18.557 -6.661 1.00 25.00 H new ATOM 1106 N GLU A 151 81.767 20.672 -3.333 1.00 25.00 N ATOM 1107 CA GLU A 151 82.548 21.855 -2.917 1.00 25.00 C ATOM 1108 C GLU A 151 82.925 22.834 -4.048 1.00 25.00 C ATOM 1109 O GLU A 151 83.698 23.767 -3.839 1.00 25.00 O ATOM 1110 CB GLU A 151 83.795 21.443 -2.121 1.00 25.00 C ATOM 1111 CG GLU A 151 83.458 20.641 -0.871 1.00 25.00 C ATOM 1112 CD GLU A 151 84.581 20.672 0.151 1.00 25.00 C ATOM 1113 OE1 GLU A 151 84.623 21.638 0.948 1.00 25.00 O ATOM 1114 OE2 GLU A 151 85.410 19.738 0.170 1.00 25.00 O1- ATOM 0 H GLU A 151 80.864 20.609 -2.863 1.00 25.00 H new ATOM 0 HA GLU A 151 81.867 22.416 -2.276 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.450 20.852 -2.761 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.350 22.337 -1.835 1.00 25.00 H new ATOM 0 HG2 GLU A 151 82.548 21.038 -0.421 1.00 25.00 H new ATOM 0 HG3 GLU A 151 83.251 19.608 -1.149 1.00 25.00 H new ATOM 1121 N ARG A 152 82.324 22.673 -5.220 1.00 25.00 N ATOM 1122 CA ARG A 152 82.557 23.579 -6.350 1.00 25.00 C ATOM 1123 C ARG A 152 81.251 24.274 -6.726 1.00 25.00 C ATOM 1124 O ARG A 152 80.189 23.660 -6.679 1.00 25.00 O ATOM 1125 CB ARG A 152 83.075 22.779 -7.546 1.00 25.00 C ATOM 1126 CG ARG A 152 84.427 22.111 -7.290 1.00 25.00 C ATOM 1127 CD ARG A 152 84.825 21.221 -8.453 1.00 25.00 C ATOM 1128 NE ARG A 152 85.085 22.005 -9.673 1.00 25.00 N ATOM 1129 CZ ARG A 152 85.397 21.493 -10.858 1.00 25.00 C ATOM 1130 NH1 ARG A 152 85.507 20.202 -11.057 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 85.604 22.300 -11.862 1.00 25.00 N ATOM 0 H ARG A 152 81.666 21.919 -5.419 1.00 25.00 H new ATOM 0 HA ARG A 152 83.296 24.329 -6.068 1.00 25.00 H new ATOM 0 HB2 ARG A 152 82.344 22.014 -7.806 1.00 25.00 H new ATOM 0 HB3 ARG A 152 83.163 23.442 -8.407 1.00 25.00 H new ATOM 0 HG2 ARG A 152 85.190 22.874 -7.134 1.00 25.00 H new ATOM 0 HG3 ARG A 152 84.377 21.519 -6.376 1.00 25.00 H new ATOM 0 HD2 ARG A 152 85.717 20.653 -8.188 1.00 25.00 H new ATOM 0 HD3 ARG A 152 84.032 20.498 -8.646 1.00 25.00 H new ATOM 0 HE ARG A 152 85.020 23.020 -9.602 1.00 25.00 H new ATOM 0 HH11 ARG A 152 85.351 19.552 -10.286 1.00 25.00 H new ATOM 0 HH12 ARG A 152 85.748 19.847 -11.982 1.00 25.00 H new ATOM 0 HH21 ARG A 152 85.525 23.308 -11.730 1.00 25.00 H new ATOM 0 HH22 ARG A 152 85.844 21.923 -12.779 1.00 25.00 H new ATOM 1145 N PRO A 153 81.300 25.566 -7.088 1.00 25.00 N ATOM 1146 CA PRO A 153 80.013 26.159 -7.461 1.00 25.00 C ATOM 1147 C PRO A 153 79.516 25.637 -8.804 1.00 25.00 C ATOM 1148 O PRO A 153 80.306 25.312 -9.696 1.00 25.00 O ATOM 1149 CB PRO A 153 80.334 27.653 -7.535 1.00 25.00 C ATOM 1150 CG PRO A 153 81.759 27.695 -7.941 1.00 25.00 C ATOM 1151 CD PRO A 153 82.398 26.541 -7.204 1.00 25.00 C ATOM 0 HA PRO A 153 79.217 25.919 -6.756 1.00 25.00 H new ATOM 0 HB2 PRO A 153 79.698 28.162 -8.259 1.00 25.00 H new ATOM 0 HB3 PRO A 153 80.178 28.143 -6.574 1.00 25.00 H new ATOM 0 HG2 PRO A 153 81.867 27.585 -9.020 1.00 25.00 H new ATOM 0 HG3 PRO A 153 82.221 28.644 -7.669 1.00 25.00 H new ATOM 0 HD2 PRO A 153 83.244 26.131 -7.755 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.771 26.845 -6.226 1.00 25.00 H new ATOM 1159 N LEU A 154 78.205 25.583 -8.950 1.00 25.00 N ATOM 1160 CA LEU A 154 77.585 25.194 -10.213 1.00 25.00 C ATOM 1161 C LEU A 154 77.338 26.482 -10.984 1.00 0.00 C ATOM 1162 O LEU A 154 77.012 27.503 -10.383 1.00 25.00 O ATOM 1163 CB LEU A 154 76.258 24.475 -9.973 1.00 25.00 C ATOM 1164 CG LEU A 154 76.293 23.146 -9.198 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.884 22.722 -8.813 1.00 25.00 C ATOM 1166 CD2 LEU A 154 76.918 22.049 -10.033 1.00 25.00 C ATOM 0 H LEU A 154 77.542 25.804 -8.208 1.00 25.00 H new ATOM 0 HA LEU A 154 78.231 24.509 -10.762 1.00 25.00 H new ATOM 0 HB2 LEU A 154 75.599 25.158 -9.437 1.00 25.00 H new ATOM 0 HB3 LEU A 154 75.799 24.285 -10.943 1.00 25.00 H new ATOM 0 HG LEU A 154 76.893 23.302 -8.301 1.00 25.00 H new ATOM 0 HD11 LEU A 154 74.924 21.780 -8.265 1.00 25.00 H new ATOM 0 HD12 LEU A 154 74.432 23.489 -8.184 1.00 25.00 H new ATOM 0 HD13 LEU A 154 74.284 22.593 -9.714 1.00 25.00 H new ATOM 0 HD21 LEU A 154 76.931 21.120 -9.463 1.00 25.00 H new ATOM 0 HD22 LEU A 154 76.335 21.908 -10.943 1.00 25.00 H new ATOM 0 HD23 LEU A 154 77.939 22.328 -10.295 1.00 25.00 H new ATOM 1178 N THR A 155 77.532 26.455 -12.296 1.00 25.00 N ATOM 1179 CA THR A 155 77.437 27.676 -13.106 1.00 25.00 C ATOM 1180 C THR A 155 76.518 27.576 -14.327 1.00 25.00 C ATOM 1181 O THR A 155 75.761 28.499 -14.610 1.00 25.00 O ATOM 1182 CB THR A 155 78.842 28.083 -13.611 1.00 25.00 C ATOM 1183 OG1 THR A 155 79.430 26.985 -14.318 1.00 25.00 O ATOM 1184 CG2 THR A 155 79.767 28.434 -12.447 1.00 25.00 C ATOM 0 H THR A 155 77.755 25.611 -12.824 1.00 25.00 H new ATOM 0 HA THR A 155 77.001 28.418 -12.437 1.00 25.00 H new ATOM 0 HB THR A 155 78.724 28.953 -14.258 1.00 25.00 H new ATOM 0 HG1 THR A 155 80.319 27.242 -14.640 1.00 25.00 H new ATOM 0 HG21 THR A 155 80.747 28.716 -12.833 1.00 25.00 H new ATOM 0 HG22 THR A 155 79.345 29.267 -11.885 1.00 25.00 H new ATOM 0 HG23 THR A 155 79.870 27.570 -11.791 1.00 25.00 H new ATOM 1192 N ASP A 156 76.596 26.479 -15.066 1.00 25.00 N ATOM 1193 CA ASP A 156 75.811 26.330 -16.293 1.00 25.00 C ATOM 1194 C ASP A 156 74.413 25.796 -15.971 1.00 25.00 C ATOM 1195 O ASP A 156 74.213 24.595 -15.772 1.00 25.00 O ATOM 1196 CB ASP A 156 76.539 25.410 -17.272 1.00 25.00 C ATOM 1197 CG ASP A 156 75.926 25.432 -18.656 1.00 25.00 C ATOM 1198 OD1 ASP A 156 74.817 25.983 -18.824 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 76.559 24.882 -19.584 1.00 25.00 O1- ATOM 0 H ASP A 156 77.190 25.680 -14.843 1.00 25.00 H new ATOM 0 HA ASP A 156 75.697 27.307 -16.762 1.00 25.00 H new ATOM 0 HB2 ASP A 156 77.585 25.709 -17.337 1.00 25.00 H new ATOM 0 HB3 ASP A 156 76.523 24.390 -16.887 1.00 25.00 H new ATOM 1204 N ASN A 157 73.462 26.715 -15.867 1.00 25.00 N ATOM 1205 CA ASN A 157 72.099 26.386 -15.443 1.00 25.00 C ATOM 1206 C ASN A 157 71.317 25.540 -16.447 1.00 25.00 C ATOM 1207 O ASN A 157 70.328 24.913 -16.088 1.00 25.00 O ATOM 1208 CB ASN A 157 71.305 27.674 -15.194 1.00 25.00 C ATOM 1209 CG ASN A 157 71.826 28.461 -14.024 1.00 25.00 C ATOM 1210 OD1 ASN A 157 71.928 27.959 -12.912 1.00 25.00 O ATOM 1211 ND2 ASN A 157 72.150 29.702 -14.261 1.00 25.00 N ATOM 0 H ASN A 157 73.607 27.704 -16.071 1.00 25.00 H new ATOM 0 HA ASN A 157 72.214 25.794 -14.535 1.00 25.00 H new ATOM 0 HB2 ASN A 157 71.339 28.296 -16.089 1.00 25.00 H new ATOM 0 HB3 ASN A 157 70.259 27.423 -15.020 1.00 25.00 H new ATOM 0 HD21 ASN A 157 72.503 30.290 -13.506 1.00 25.00 H new ATOM 0 HD22 ASN A 157 72.051 30.084 -15.201 1.00 25.00 H new ATOM 1218 N HIS A 158 71.729 25.558 -17.704 1.00 25.00 N ATOM 1219 CA HIS A 158 70.974 24.885 -18.760 1.00 25.00 C ATOM 1220 C HIS A 158 71.153 23.372 -18.731 1.00 25.00 C ATOM 1221 O HIS A 158 70.417 22.635 -19.373 1.00 25.00 O ATOM 1222 CB HIS A 158 71.434 25.408 -20.120 1.00 25.00 C ATOM 1223 CG HIS A 158 71.590 26.897 -20.166 1.00 25.00 C ATOM 1224 ND1 HIS A 158 72.789 27.548 -20.029 1.00 25.00 N ATOM 1225 CD2 HIS A 158 70.667 27.885 -20.327 1.00 25.00 C ATOM 1226 CE1 HIS A 158 72.567 28.854 -20.114 1.00 25.00 C ATOM 1227 NE2 HIS A 158 71.289 29.119 -20.288 1.00 25.00 N ATOM 0 H HIS A 158 72.577 26.027 -18.022 1.00 25.00 H new ATOM 0 HA HIS A 158 69.919 25.100 -18.592 1.00 25.00 H new ATOM 0 HB2 HIS A 158 72.386 24.943 -20.376 1.00 25.00 H new ATOM 0 HB3 HIS A 158 70.715 25.102 -20.880 1.00 25.00 H new ATOM 0 HD1 HIS A 158 73.696 27.105 -19.886 1.00 25.00 H new ATOM 0 HD2 HIS A 158 69.607 27.728 -20.465 1.00 25.00 H new ATOM 0 HE1 HIS A 158 73.339 29.606 -20.049 1.00 25.00 H new ATOM 1235 N ARG A 159 72.179 22.909 -18.032 1.00 25.00 N ATOM 1236 CA ARG A 159 72.479 21.480 -18.000 1.00 25.00 C ATOM 1237 C ARG A 159 71.553 20.732 -17.067 1.00 25.00 C ATOM 1238 O ARG A 159 71.152 21.247 -16.023 1.00 25.00 O ATOM 1239 CB ARG A 159 73.914 21.247 -17.548 1.00 25.00 C ATOM 1240 CG ARG A 159 74.915 21.868 -18.468 1.00 25.00 C ATOM 1241 CD ARG A 159 76.322 21.451 -18.118 1.00 25.00 C ATOM 1242 NE ARG A 159 77.272 22.276 -18.872 1.00 25.00 N ATOM 1243 CZ ARG A 159 78.574 22.070 -18.972 1.00 25.00 C ATOM 1244 NH1 ARG A 159 79.173 21.052 -18.400 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 79.279 22.915 -19.667 1.00 25.00 N ATOM 0 H ARG A 159 72.813 23.492 -17.485 1.00 25.00 H new ATOM 0 HA ARG A 159 72.337 21.104 -19.013 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.046 21.654 -16.546 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.101 20.175 -17.484 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.694 21.580 -19.496 1.00 25.00 H new ATOM 0 HG3 ARG A 159 74.833 22.954 -18.417 1.00 25.00 H new ATOM 0 HD2 ARG A 159 76.492 21.566 -17.048 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.471 20.397 -18.353 1.00 25.00 H new ATOM 0 HE ARG A 159 76.893 23.084 -19.365 1.00 25.00 H new ATOM 0 HH11 ARG A 159 78.631 20.383 -17.853 1.00 25.00 H new ATOM 0 HH12 ARG A 159 80.180 20.930 -18.502 1.00 25.00 H new ATOM 0 HH21 ARG A 159 78.825 23.710 -20.116 1.00 25.00 H new ATOM 0 HH22 ARG A 159 80.286 22.782 -19.762 1.00 25.00 H new ATOM 1259 N SER A 160 71.290 19.489 -17.418 1.00 25.00 N ATOM 1260 CA SER A 160 70.526 18.593 -16.573 1.00 25.00 C ATOM 1261 C SER A 160 71.349 18.205 -15.348 1.00 25.00 C ATOM 1262 O SER A 160 72.579 18.241 -15.378 1.00 25.00 O ATOM 1263 CB SER A 160 70.176 17.341 -17.362 1.00 25.00 C ATOM 1264 OG SER A 160 69.848 17.689 -18.696 1.00 25.00 O ATOM 0 H SER A 160 71.599 19.072 -18.296 1.00 25.00 H new ATOM 0 HA SER A 160 69.614 19.094 -16.247 1.00 25.00 H new ATOM 0 HB2 SER A 160 71.017 16.648 -17.354 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.336 16.828 -16.894 1.00 25.00 H new ATOM 0 HG SER A 160 69.334 16.963 -19.106 1.00 25.00 H new ATOM 1270 N LEU A 161 70.682 17.798 -14.284 1.00 25.00 N ATOM 1271 CA LEU A 161 71.368 17.380 -13.058 1.00 25.00 C ATOM 1272 C LEU A 161 72.198 16.111 -13.295 1.00 25.00 C ATOM 1273 O LEU A 161 73.324 15.976 -12.785 1.00 25.00 O ATOM 1274 CB LEU A 161 70.326 17.162 -11.957 1.00 25.00 C ATOM 1275 CG LEU A 161 69.499 18.416 -11.614 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.345 18.029 -10.721 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.337 19.502 -10.942 1.00 25.00 C ATOM 0 H LEU A 161 69.665 17.745 -14.236 1.00 25.00 H new ATOM 0 HA LEU A 161 72.062 18.161 -12.747 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.648 16.367 -12.266 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.833 16.817 -11.056 1.00 25.00 H new ATOM 0 HG LEU A 161 69.127 18.832 -12.551 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.760 18.916 -10.478 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.712 17.307 -11.237 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.729 17.585 -9.803 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.707 20.364 -10.721 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.759 19.114 -10.015 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.144 19.804 -11.610 1.00 25.00 H new ATOM 1289 N ALA A 162 71.696 15.221 -14.141 1.00 25.00 N ATOM 1290 CA ALA A 162 72.438 14.016 -14.516 1.00 25.00 C ATOM 1291 C ALA A 162 73.764 14.370 -15.202 1.00 25.00 C ATOM 1292 O ALA A 162 74.745 13.646 -15.073 1.00 25.00 O ATOM 1293 CB ALA A 162 71.591 13.145 -15.436 1.00 25.00 C ATOM 0 H ALA A 162 70.780 15.307 -14.582 1.00 25.00 H new ATOM 0 HA ALA A 162 72.666 13.463 -13.605 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.152 12.251 -15.709 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.675 12.855 -14.921 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.339 13.705 -16.337 1.00 25.00 H new ATOM 1299 N SER A 163 73.802 15.500 -15.894 1.00 25.00 N ATOM 1300 CA SER A 163 75.016 15.949 -16.580 1.00 25.00 C ATOM 1301 C SER A 163 76.105 16.385 -15.599 1.00 25.00 C ATOM 1302 O SER A 163 77.275 16.475 -15.966 1.00 25.00 O ATOM 1303 CB SER A 163 74.685 17.098 -17.528 1.00 25.00 C ATOM 1304 OG SER A 163 73.574 16.751 -18.339 1.00 25.00 O ATOM 0 H SER A 163 73.005 16.128 -15.998 1.00 25.00 H new ATOM 0 HA SER A 163 75.402 15.101 -17.146 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.462 17.999 -16.957 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.548 17.323 -18.155 1.00 25.00 H new ATOM 0 HG SER A 163 73.366 17.493 -18.944 1.00 25.00 H new ATOM 1310 N TYR A 164 75.728 16.627 -14.349 1.00 25.00 N ATOM 1311 CA TYR A 164 76.699 16.936 -13.297 1.00 25.00 C ATOM 1312 C TYR A 164 76.983 15.689 -12.467 1.00 25.00 C ATOM 1313 O TYR A 164 77.838 15.706 -11.590 1.00 25.00 O ATOM 1314 CB TYR A 164 76.164 18.029 -12.372 1.00 25.00 C ATOM 1315 CG TYR A 164 76.187 19.403 -12.989 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.390 20.136 -13.052 1.00 25.00 C ATOM 1317 CD2 TYR A 164 75.015 19.989 -13.503 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.420 21.438 -13.608 1.00 25.00 C ATOM 1319 CE2 TYR A 164 75.042 21.293 -14.060 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.246 22.006 -14.099 1.00 25.00 C ATOM 1321 OH TYR A 164 76.300 23.274 -14.612 1.00 25.00 O ATOM 0 H TYR A 164 74.757 16.616 -14.036 1.00 25.00 H new ATOM 0 HA TYR A 164 77.615 17.284 -13.775 1.00 25.00 H new ATOM 0 HB2 TYR A 164 75.141 17.784 -12.087 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.755 18.041 -11.456 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.301 19.698 -12.671 1.00 25.00 H new ATOM 0 HD2 TYR A 164 74.085 19.440 -13.473 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.348 21.988 -13.651 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.138 21.734 -14.452 1.00 25.00 H new ATOM 0 HH TYR A 164 75.423 23.517 -14.976 1.00 25.00 H new ATOM 1331 N GLY A 165 76.250 14.619 -12.735 1.00 25.00 N ATOM 1332 CA GLY A 165 76.385 13.399 -11.956 1.00 25.00 C ATOM 1333 C GLY A 165 75.602 13.472 -10.661 1.00 25.00 C ATOM 1334 O GLY A 165 75.894 12.739 -9.712 1.00 25.00 O ATOM 0 H GLY A 165 75.558 14.571 -13.483 1.00 25.00 H new ATOM 0 HA2 GLY A 165 76.036 12.551 -12.545 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.438 13.223 -11.735 1.00 25.00 H new ATOM 1338 N LEU A 166 74.606 14.352 -10.607 1.00 25.00 N ATOM 1339 CA LEU A 166 73.805 14.518 -9.392 1.00 25.00 C ATOM 1340 C LEU A 166 72.813 13.369 -9.241 1.00 25.00 C ATOM 1341 O LEU A 166 71.659 13.454 -9.626 1.00 25.00 O ATOM 1342 CB LEU A 166 73.094 15.867 -9.404 1.00 25.00 C ATOM 1343 CG LEU A 166 74.003 17.020 -8.973 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.517 18.360 -9.482 1.00 25.00 C ATOM 1345 CD2 LEU A 166 74.066 17.045 -7.454 1.00 25.00 C ATOM 0 H LEU A 166 74.334 14.957 -11.381 1.00 25.00 H new ATOM 0 HA LEU A 166 74.471 14.497 -8.529 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.715 16.064 -10.407 1.00 25.00 H new ATOM 0 HB3 LEU A 166 72.231 15.823 -8.740 1.00 25.00 H new ATOM 0 HG LEU A 166 74.990 16.852 -9.404 1.00 25.00 H new ATOM 0 HD11 LEU A 166 74.197 19.144 -9.149 1.00 25.00 H new ATOM 0 HD12 LEU A 166 73.486 18.346 -10.571 1.00 25.00 H new ATOM 0 HD13 LEU A 166 72.518 18.556 -9.093 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.711 17.862 -7.130 1.00 25.00 H new ATOM 0 HD22 LEU A 166 73.064 17.192 -7.051 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.469 16.099 -7.091 1.00 25.00 H new ATOM 1357 N LYS A 167 73.345 12.279 -8.720 1.00 25.00 N ATOM 1358 CA LYS A 167 72.637 11.013 -8.502 1.00 25.00 C ATOM 1359 C LYS A 167 71.665 11.033 -7.318 1.00 25.00 C ATOM 1360 O LYS A 167 71.699 11.927 -6.463 1.00 25.00 O ATOM 1361 CB LYS A 167 73.699 9.944 -8.214 1.00 25.00 C ATOM 1362 CG LYS A 167 74.475 10.264 -6.936 1.00 25.00 C ATOM 1363 CD LYS A 167 75.623 9.349 -6.672 1.00 25.00 C ATOM 1364 CE LYS A 167 76.280 9.807 -5.379 1.00 25.00 C ATOM 1365 NZ LYS A 167 77.529 9.061 -5.084 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.320 12.241 -8.423 1.00 25.00 H new ATOM 0 HA LYS A 167 72.043 10.816 -9.394 1.00 25.00 H new ATOM 0 HB2 LYS A 167 73.221 8.969 -8.117 1.00 25.00 H new ATOM 0 HB3 LYS A 167 74.390 9.878 -9.055 1.00 25.00 H new ATOM 0 HG2 LYS A 167 74.847 11.287 -6.997 1.00 25.00 H new ATOM 0 HG3 LYS A 167 73.790 10.223 -6.089 1.00 25.00 H new ATOM 0 HD2 LYS A 167 75.280 8.318 -6.584 1.00 25.00 H new ATOM 0 HD3 LYS A 167 76.335 9.379 -7.496 1.00 25.00 H new ATOM 0 HE2 LYS A 167 76.503 10.872 -5.445 1.00 25.00 H new ATOM 0 HE3 LYS A 167 75.580 9.679 -4.554 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 77.939 9.409 -4.194 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 77.315 8.047 -4.994 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 78.209 9.203 -5.858 1.00 25.00 H new ATOM 1379 N ASP A 168 70.891 9.963 -7.209 1.00 25.00 N ATOM 1380 CA ASP A 168 70.028 9.751 -6.054 1.00 25.00 C ATOM 1381 C ASP A 168 70.858 9.792 -4.776 1.00 25.00 C ATOM 1382 O ASP A 168 71.872 9.097 -4.646 1.00 25.00 O ATOM 1383 CB ASP A 168 69.347 8.377 -6.108 1.00 25.00 C ATOM 1384 CG ASP A 168 68.503 8.187 -7.329 1.00 25.00 C ATOM 1385 OD1 ASP A 168 69.059 8.075 -8.445 1.00 25.00 O ATOM 1386 OD2 ASP A 168 67.273 8.104 -7.164 1.00 25.00 O1- ATOM 0 H ASP A 168 70.842 9.224 -7.910 1.00 25.00 H new ATOM 0 HA ASP A 168 69.274 10.538 -6.066 1.00 25.00 H new ATOM 0 HB2 ASP A 168 70.110 7.599 -6.076 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.726 8.251 -5.221 1.00 25.00 H new ATOM 1391 N GLY A 169 70.412 10.598 -3.830 1.00 25.00 N ATOM 1392 CA GLY A 169 71.049 10.674 -2.533 1.00 25.00 C ATOM 1393 C GLY A 169 72.178 11.674 -2.479 1.00 25.00 C ATOM 1394 O GLY A 169 72.771 11.864 -1.418 1.00 25.00 O ATOM 0 H GLY A 169 69.605 11.212 -3.939 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.302 10.939 -1.784 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.432 9.689 -2.266 1.00 25.00 H new ATOM 1398 N ASP A 170 72.496 12.319 -3.593 1.00 25.00 N ATOM 1399 CA ASP A 170 73.565 13.311 -3.569 1.00 25.00 C ATOM 1400 C ASP A 170 73.075 14.616 -2.947 1.00 25.00 C ATOM 1401 O ASP A 170 71.864 14.861 -2.855 1.00 25.00 O ATOM 1402 CB ASP A 170 74.121 13.547 -4.962 1.00 25.00 C ATOM 1403 CG ASP A 170 75.633 13.656 -4.959 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.198 14.087 -3.929 1.00 25.00 O ATOM 1405 OD2 ASP A 170 76.270 13.245 -5.952 1.00 25.00 O1- ATOM 0 H ASP A 170 72.047 12.181 -4.498 1.00 25.00 H new ATOM 0 HA ASP A 170 74.374 12.923 -2.950 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.818 12.730 -5.617 1.00 25.00 H new ATOM 0 HB3 ASP A 170 73.692 14.461 -5.373 1.00 25.00 H new ATOM 1410 N VAL A 171 74.012 15.424 -2.470 1.00 25.00 N ATOM 1411 CA VAL A 171 73.684 16.623 -1.694 1.00 25.00 C ATOM 1412 C VAL A 171 74.272 17.887 -2.319 1.00 25.00 C ATOM 1413 O VAL A 171 75.458 17.918 -2.667 1.00 25.00 O ATOM 1414 CB VAL A 171 74.237 16.497 -0.233 1.00 25.00 C ATOM 1415 CG1 VAL A 171 73.694 17.631 0.664 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.868 15.126 0.378 1.00 25.00 C ATOM 0 H VAL A 171 75.012 15.274 -2.605 1.00 25.00 H new ATOM 0 HA VAL A 171 72.597 16.704 -1.687 1.00 25.00 H new ATOM 0 HB VAL A 171 75.323 16.580 -0.283 1.00 25.00 H new ATOM 0 HG11 VAL A 171 74.093 17.520 1.672 1.00 25.00 H new ATOM 0 HG12 VAL A 171 73.999 18.595 0.257 1.00 25.00 H new ATOM 0 HG13 VAL A 171 72.606 17.579 0.697 1.00 25.00 H new ATOM 0 HG21 VAL A 171 74.262 15.062 1.392 1.00 25.00 H new ATOM 0 HG22 VAL A 171 72.784 15.019 0.403 1.00 25.00 H new ATOM 0 HG23 VAL A 171 74.297 14.329 -0.230 1.00 25.00 H new ATOM 1426 N VAL A 172 73.482 18.953 -2.399 1.00 25.00 N ATOM 1427 CA VAL A 172 74.000 20.250 -2.837 1.00 25.00 C ATOM 1428 C VAL A 172 73.850 21.225 -1.679 1.00 25.00 C ATOM 1429 O VAL A 172 73.050 21.000 -0.771 1.00 25.00 O ATOM 1430 CB VAL A 172 73.269 20.791 -4.098 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.477 19.848 -5.279 1.00 25.00 C ATOM 1432 CG2 VAL A 172 71.780 20.963 -3.838 1.00 25.00 C ATOM 0 H VAL A 172 72.488 18.948 -2.169 1.00 25.00 H new ATOM 0 HA VAL A 172 75.046 20.133 -3.120 1.00 25.00 H new ATOM 0 HB VAL A 172 73.694 21.766 -4.336 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.959 20.241 -6.154 1.00 25.00 H new ATOM 0 HG12 VAL A 172 74.542 19.765 -5.495 1.00 25.00 H new ATOM 0 HG13 VAL A 172 73.079 18.864 -5.033 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.295 21.343 -4.737 1.00 25.00 H new ATOM 0 HG22 VAL A 172 71.344 20.001 -3.569 1.00 25.00 H new ATOM 0 HG23 VAL A 172 71.633 21.669 -3.021 1.00 25.00 H new ATOM 1442 N ILE A 173 74.633 22.292 -1.693 1.00 25.00 N ATOM 1443 CA ILE A 173 74.601 23.286 -0.627 1.00 25.00 C ATOM 1444 C ILE A 173 74.353 24.656 -1.244 1.00 25.00 C ATOM 1445 O ILE A 173 75.171 25.164 -2.004 1.00 25.00 O ATOM 1446 CB ILE A 173 75.930 23.311 0.195 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.245 21.901 0.748 1.00 25.00 C ATOM 1448 CG2 ILE A 173 75.814 24.333 1.363 1.00 25.00 C ATOM 1449 CD1 ILE A 173 77.627 21.767 1.414 1.00 25.00 C ATOM 0 H ILE A 173 75.303 22.494 -2.435 1.00 25.00 H new ATOM 0 HA ILE A 173 73.799 23.022 0.063 1.00 25.00 H new ATOM 0 HB ILE A 173 76.744 23.617 -0.462 1.00 25.00 H new ATOM 0 HG12 ILE A 173 75.479 21.631 1.474 1.00 25.00 H new ATOM 0 HG13 ILE A 173 76.179 21.182 -0.068 1.00 25.00 H new ATOM 0 HG21 ILE A 173 76.744 24.344 1.931 1.00 25.00 H new ATOM 0 HG22 ILE A 173 75.624 25.327 0.959 1.00 25.00 H new ATOM 0 HG23 ILE A 173 74.992 24.045 2.019 1.00 25.00 H new ATOM 0 HD11 ILE A 173 77.761 20.746 1.772 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.405 22.002 0.688 1.00 25.00 H new ATOM 0 HD13 ILE A 173 77.694 22.458 2.254 1.00 25.00 H new ATOM 1461 N LEU A 174 73.219 25.249 -0.921 1.00 25.00 N ATOM 1462 CA LEU A 174 72.867 26.577 -1.409 1.00 25.00 C ATOM 1463 C LEU A 174 73.256 27.568 -0.321 1.00 25.00 C ATOM 1464 O LEU A 174 72.964 27.345 0.841 1.00 25.00 O ATOM 1465 CB LEU A 174 71.366 26.645 -1.699 1.00 25.00 C ATOM 1466 CG LEU A 174 70.882 27.998 -2.237 1.00 25.00 C ATOM 1467 CD1 LEU A 174 70.001 27.801 -3.461 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.114 28.749 -1.158 1.00 25.00 C ATOM 0 H LEU A 174 72.515 24.828 -0.315 1.00 25.00 H new ATOM 0 HA LEU A 174 73.389 26.809 -2.337 1.00 25.00 H new ATOM 0 HB2 LEU A 174 71.113 25.869 -2.422 1.00 25.00 H new ATOM 0 HB3 LEU A 174 70.821 26.417 -0.783 1.00 25.00 H new ATOM 0 HG LEU A 174 71.753 28.586 -2.526 1.00 25.00 H new ATOM 0 HD11 LEU A 174 69.667 28.771 -3.829 1.00 25.00 H new ATOM 0 HD12 LEU A 174 70.569 27.293 -4.240 1.00 25.00 H new ATOM 0 HD13 LEU A 174 69.134 27.197 -3.192 1.00 25.00 H new ATOM 0 HD21 LEU A 174 69.776 29.707 -1.552 1.00 25.00 H new ATOM 0 HD22 LEU A 174 69.251 28.159 -0.848 1.00 25.00 H new ATOM 0 HD23 LEU A 174 70.764 28.919 -0.300 1.00 25.00 H new ATOM 1480 N ARG A 175 73.951 28.636 -0.685 1.00 25.00 N ATOM 1481 CA ARG A 175 74.415 29.630 0.287 1.00 25.00 C ATOM 1482 C ARG A 175 73.943 31.031 -0.072 1.00 25.00 C ATOM 1483 O ARG A 175 74.295 31.562 -1.126 1.00 25.00 O ATOM 1484 CB ARG A 175 75.946 29.616 0.359 1.00 25.00 C ATOM 1485 CG ARG A 175 76.524 28.286 0.831 1.00 25.00 C ATOM 1486 CD ARG A 175 78.024 28.383 1.045 1.00 25.00 C ATOM 1487 NE ARG A 175 78.571 27.121 1.574 1.00 25.00 N ATOM 1488 CZ ARG A 175 79.844 26.907 1.892 1.00 25.00 C ATOM 1489 NH1 ARG A 175 80.766 27.829 1.749 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 80.197 25.744 2.362 1.00 25.00 N ATOM 0 H ARG A 175 74.210 28.842 -1.650 1.00 25.00 H new ATOM 0 HA ARG A 175 73.992 29.364 1.256 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.350 29.848 -0.626 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.277 30.406 1.033 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.040 27.986 1.761 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.309 27.511 0.095 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.513 28.627 0.102 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.243 29.196 1.738 1.00 25.00 H new ATOM 0 HE ARG A 175 77.919 26.348 1.707 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.516 28.748 1.383 1.00 25.00 H new ATOM 0 HH12 ARG A 175 81.733 27.627 2.004 1.00 25.00 H new ATOM 0 HH21 ARG A 175 79.500 25.010 2.482 1.00 25.00 H new ATOM 0 HH22 ARG A 175 81.171 25.568 2.609 1.00 25.00 H new ATOM 1504 N GLN A 176 73.179 31.645 0.836 1.00 25.00 N ATOM 1505 CA GLN A 176 72.736 33.048 0.716 1.00 25.00 C ATOM 1506 C GLN A 176 73.511 33.941 1.688 1.00 25.00 C ATOM 1507 O GLN A 176 73.552 33.796 2.896 1.00 25.00 O ATOM 1508 CB GLN A 176 71.213 33.210 0.932 1.00 25.00 C ATOM 1509 CG GLN A 176 70.767 34.646 0.557 1.00 25.00 C ATOM 1510 CD GLN A 176 69.297 34.873 0.809 1.00 25.00 C ATOM 1511 OE1 GLN A 176 68.747 34.578 1.841 1.00 25.00 O ATOM 1512 NE2 GLN A 176 68.623 35.459 -0.160 1.00 25.00 N ATOM 1513 OXT GLN A 176 74.121 34.823 1.149 1.00 25.00 O ATOM 0 H GLN A 176 72.845 31.184 1.683 1.00 25.00 H new ATOM 0 HA GLN A 176 72.949 33.361 -0.306 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.673 32.484 0.324 1.00 25.00 H new ATOM 0 HB3 GLN A 176 70.962 33.004 1.973 1.00 25.00 H new ATOM 0 HG2 GLN A 176 71.348 35.366 1.133 1.00 25.00 H new ATOM 0 HG3 GLN A 176 70.986 34.829 -0.495 1.00 25.00 H new ATOM 0 HE21 GLN A 176 69.093 35.706 -1.031 1.00 25.00 H new ATOM 0 HE22 GLN A 176 67.631 35.665 -0.039 1.00 25.00 H new